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2-[2-(2',6'-Dichloro-4'-hydroxphenylamino)phenyl]-N,N-dimethylacetamide-[d4]

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General Information
Catalog: BLP-006350
CAS: 1382084-40-3
Molecular Formula: C16H12D4Cl2N2O2
Molecular Weight: 343.24

Chemical Structure

Description	2-[2-(2',6'-Dichloro-4'-hydroxphenylamino)phenyl]-N,N-dimethylacetamide-[d4] is the labelled analogue of 2-[2-(2',6'-Dichloro-4'-hydroxphenylamino)phenyl]-N,N-dimethylacetamide, which is a metabolite of Diclofenac.
Synonyms	2-[2-(2',6'-Dichloro-4'-hydroxphenylamino)phenyl-d4]-N,N-dimethylacetamide; 2-[(2,6-Dichloro-4-hydroxyphenyl)amino]-N,N-dimethyl-benzene-d4-acetamide
IUPAC Name	N,N-dimethyl-2-[2,3,4,5-tetradeuterio-6-(2,6-dichloro-4-hydroxyanilino)phenyl]acetamide
Related CAS	698357-45-8 (unlabelled)
Canonical SMILES	CN(C)C(=O)CC1=CC=CC=C1NC2=C(C=C(C=C2Cl)O)Cl
InChI	InChI=1S/C16H16Cl2N2O2/c1-20(2)15(22)7-10-5-3-4-6-14(10)19-16-12(17)8-11(21)9-13(16)18/h3-6,8-9,19,21H,7H2,1-2H3/i3D,4D,5D,6D
InChI Key	PHEVCOKHWYKTOS-LNFUJOGGSA-N
Purity	>98%
Solubility	Slightly soluble in DMSO
Appearance	Light Purple Solid
Storage	Store at -20°C